4-(2,2-difluoroethyl)piperazin-2-one

C6H10F2N2O — CID 130927881

IUPAC4-(2,2-difluoroethyl)piperazin-2-one
SMILESO=C1CN(CC(F)F)CCN1
InChIInChI=1S/C6H10F2N2O/c7-5(8)3-10-2-1-9-6(11)4-10/h5H,1-4H2,(H,9,11)
InChIKeyRNSSUIFYDYBIBK-UHFFFAOYSA-N
MW164.16 g/mol
LogP-0.32
Rot. Bonds2

About 4-(2,2-difluoroethyl)piperazin-2-one

4-(2,2-difluoroethyl)piperazin-2-one (PubChem CID 130927881) has the molecular formula C6H10F2N2O and a molecular weight of 164.16 g/mol. Its IUPAC name is 4-(2,2-difluoroethyl)piperazin-2-one.

Molecular Properties

Compound Name4-(2,2-difluoroethyl)piperazin-2-one
PubChem CID130927881
Molecular FormulaC6H10F2N2O
Molecular Weight164.16 g/mol
Exact Mass164.08
IUPAC Name4-(2,2-difluoroethyl)piperazin-2-one
SMILESO=C1CN(CC(F)F)CCN1
InChIInChI=1S/C6H10F2N2O/c7-5(8)3-10-2-1-9-6(11)4-10/h5H,1-4H2,(H,9,11)
InChIKeyRNSSUIFYDYBIBK-UHFFFAOYSA-N
XLogP-0.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(2,2-difluoroethyl)piperazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-difluoroethyl)piperazin-2-one?
The IUPAC name of 4-(2,2-difluoroethyl)piperazin-2-one (CID 130927881) is 4-(2,2-difluoroethyl)piperazin-2-one.
What is the SMILES notation for 4-(2,2-difluoroethyl)piperazin-2-one?
The canonical SMILES for 4-(2,2-difluoroethyl)piperazin-2-one is O=C1CN(CC(F)F)CCN1.
What is the InChIKey of 4-(2,2-difluoroethyl)piperazin-2-one?
The InChIKey is RNSSUIFYDYBIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2N2O/c7-5(8)3-10-2-1-9-6(11)4-10/h5H,1-4H2,(H,9,11).
What are the key properties of 4-(2,2-difluoroethyl)piperazin-2-one?
4-(2,2-difluoroethyl)piperazin-2-one has a molecular weight of 164.16 g/mol, XLogP of -0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-difluoroethyl)piperazin-2-one is sourced from PubChem (CID 130927881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).